methyl 3-[[(2S)-1-methoxy-3-[4-(2-methoxyphenyl)phenyl]-1-oxidanylidene-propan-2-yl]carbamoyl]adamantane-1-carboxylate

Systemtic Name: methyl 3-[[(2S)-1-methoxy-3-[4-(2-methoxyphenyl)phenyl]-1-oxidanylidene-propan-2-yl]carbamoyl]adamantane-1-carboxylate Openeye Name: methyl 3-[[(1S)-2-methoxy-1-[[4-(2-methoxyphenyl)phenyl]methyl]-2-oxo-ethyl]carbamoyl]adamantane-1-carboxylate CAS Name: 3-[[[(2S)-1-methoxy-3-[4-(2-methoxyphenyl)phenyl]-1-oxopropan-2-yl]amino]-oxomethyl]-1-adamantanecarboxylic acid methyl ester IUPAC Name: methyl 3-[[(2S)-1-methoxy-3-[4-(2-methoxyphenyl)phenyl]-1-oxopropan-2-yl]carbamoyl]adamantane-1-carboxylate Traditional Name: 3-[[(1S)-2-keto-2-methoxy-1-[4-(2-methoxyphenyl)benzyl]ethyl]carbamoyl]adamantane-1-carboxylic acid methyl ester Formula: C30H35NO6 MolecularWeight: 505.602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CC=C(C=C2)CC(C(=O)OC)NC(=O)C34CC5CC(C3)CC(C5)(C4)C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1C2=CC=C(C=C2)C[C@@H](C(=O)OC)NC(=O)C34CC5CC(C3)CC(C5)(C4)C(=O)OC

InChI

InChI=1S/C30H35NO6/c1-35-25-7-5-4-6-23(25)22-10-8-19(9-11-22)13-24(26(32)36-2)31-27(33)29-14-20-12-21(15-29)17-30(16-20,18-29)28(34)37-3/h4-11,20-21,24H,12-18H2,1-3H3,(H,31,33)/t20?,21?,24-,29?,30?/m0/s1