2-adamantyl N-[1-[2-(3,4-dichlorophenyl)ethylamino]-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: 2-adamantyl N-[1-[2-(3,4-dichlorophenyl)ethylamino]-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: 2-adamantyl N-[2-[2-(3,4-dichlorophenyl)ethylamino]-1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-ethyl]carbamate CAS Name: N-[1-[2-(3,4-dichlorophenyl)ethylamino]-3-(1H-indol-3-yl)-2-methyl-1-oxopropan-2-yl]carbamic acid 2-adamantyl ester IUPAC Name: 2-adamantyl N-[1-[2-(3,4-dichlorophenyl)ethylamino]-3-(1H-indol-3-yl)-2-methyl-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[2-(3,4-dichlorophenyl)ethylamino]-1-(1H-indol-3-ylmethyl)-2-keto-1-methyl-ethyl]carbamic acid 2-adamantyl ester Formula: C31H35Cl2N3O3 MolecularWeight: 568.5339

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)NCCC3=CC(=C(C=C3)Cl)Cl)NC(=O)OC4C5CC6CC(C5)CC4C6

Isomeric SMILES

CC(CC1=CNC2=CC=CC=C21)(C(=O)NCCC3=CC(=C(C=C3)Cl)Cl)NC(=O)OC4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C31H35Cl2N3O3/c1-31(16-23-17-35-27-5-3-2-4-24(23)27,29(37)34-9-8-18-6-7-25(32)26(33)15-18)36-30(38)39-28-21-11-19-10-20(13-21)14-22(28)12-19/h2-7,15,17,19-22,28,35H,8-14,16H2,1H3,(H,34,37)(H,36,38)