tert-butyl N-[2-[(2-chlorophenyl)methyl]-3-(2-methylpropanoyl)-2-propyl-indol-6-yl]carbamate

Systemtic Name: tert-butyl N-[2-[(2-chlorophenyl)methyl]-3-(2-methylpropanoyl)-2-propyl-indol-6-yl]carbamate Openeye Name: tert-butyl N-[2-[(2-chlorophenyl)methyl]-3-(2-methylpropanoyl)-2-propyl-indol-6-yl]carbamate CAS Name: N-[2-[(2-chlorophenyl)methyl]-3-(2-methyl-1-oxopropyl)-2-propyl-6-indolyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[(2-chlorophenyl)methyl]-3-(2-methylpropanoyl)-2-propylindol-6-yl]carbamate Traditional Name: N-[2-(2-chlorobenzyl)-3-isobutyryl-2-propyl-indol-6-yl]carbamic acid tert-butyl ester Formula: C27H33ClN2O3 MolecularWeight: 469.01552

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=C2C=CC(=CC2=N1)NC(=O)OC(C)(C)C)C(=O)C(C)C)CC3=CC=CC=C3Cl

Isomeric SMILES

CCCC1(C(=C2C=CC(=CC2=N1)NC(=O)OC(C)(C)C)C(=O)C(C)C)CC3=CC=CC=C3Cl

InChI

InChI=1S/C27H33ClN2O3/c1-7-14-27(16-18-10-8-9-11-21(18)28)23(24(31)17(2)3)20-13-12-19(15-22(20)30-27)29-25(32)33-26(4,5)6/h8-13,15,17H,7,14,16H2,1-6H3,(H,29,32)