2-adamantyl 2-[[1-[(2-bromophenyl)methyl-methyl-amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]carbamoyl]-4-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: 2-adamantyl 2-[[1-[(2-bromophenyl)methyl-methyl-amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]carbamoyl]-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: 2-adamantyl 2-[[2-[(2-bromophenyl)methyl-methyl-amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamoyl]-4-hydroxy-pyrrolidine-1-carboxylate CAS Name: 2-[[[1-[(2-bromophenyl)methyl-methylamino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-oxomethyl]-4-hydroxy-1-pyrrolidinecarboxylic acid 2-adamantyl ester IUPAC Name: 2-adamantyl 2-[[1-[(2-bromophenyl)methyl-methylamino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamoyl]-4-hydroxypyrrolidine-1-carboxylate Traditional Name: 2-[[2-[(2-bromobenzyl)-methyl-amino]-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]carbamoyl]-4-hydroxy-pyrrolidine-1-carboxylic acid 2-adamantyl ester Formula: C35H41BrN4O5 MolecularWeight: 677.62784

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1Br)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C4CC(CN4C(=O)OC5C6CC7CC(C6)CC5C7)O

Isomeric SMILES

CN(CC1=CC=CC=C1Br)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C4CC(CN4C(=O)OC5C6CC7CC(C6)CC5C7)O

InChI

InChI=1S/C35H41BrN4O5/c1-39(18-22-6-2-4-8-28(22)36)34(43)30(15-25-17-37-29-9-5-3-7-27(25)29)38-33(42)31-16-26(41)19-40(31)35(44)45-32-23-11-20-10-21(13-23)14-24(32)12-20/h2-9,17,20-21,23-24,26,30-32,37,41H,10-16,18-19H2,1H3,(H,38,42)