anthracen-9-ylmethyl N-[1-[(1-azanyl-2-methyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: anthracen-9-ylmethyl N-[1-[(1-azanyl-2-methyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: 9-anthrylmethyl N-[2-[(2-amino-1-benzyl-1-methyl-2-oxo-ethyl)amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamate CAS Name: N-[1-[(1-amino-2-methyl-1-oxo-3-phenylpropan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamic acid 9-anthracenylmethyl ester IUPAC Name: anthracen-9-ylmethyl N-[1-[(1-amino-2-methyl-1-oxo-3-phenylpropan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[(2-amino-1-benzyl-2-keto-1-methyl-ethyl)amino]-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]carbamic acid 9-anthrylmethyl ester Formula: C37H34N4O4 MolecularWeight: 598.69026

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)(C(=O)N)NC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)OCC4=C5C=CC=CC5=CC6=CC=CC=C64

Isomeric SMILES

CC(CC1=CC=CC=C1)(C(=O)N)NC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)OCC4=C5C=CC=CC5=CC6=CC=CC=C64

InChI

InChI=1S/C37H34N4O4/c1-37(35(38)43,21-24-11-3-2-4-12-24)41-34(42)33(20-27-22-39-32-18-10-9-17-30(27)32)40-36(44)45-23-31-28-15-7-5-13-25(28)19-26-14-6-8-16-29(26)31/h2-19,22,33,39H,20-21,23H2,1H3,(H2,38,43)(H,40,44)(H,41,42)