(phenylmethyl) N-[(2S)-1-[2-[(3-methoxyphenyl)amino]ethylamino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[2-[(3-methoxyphenyl)amino]ethylamino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[2-(3-methoxyanilino)ethylcarbamoyl]-3-methyl-butyl]carbamate CAS Name: N-[(2S)-1-[2-(3-methoxyanilino)ethylamino]-4-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[2-(3-methoxyanilino)ethylamino]-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S)-1-[2-(m-anisidino)ethylcarbamoyl]-3-methyl-butyl]carbamic acid benzyl ester Formula: C23H31N3O4 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCCNC1=CC(=CC=C1)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@@H](C(=O)NCCNC1=CC(=CC=C1)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H31N3O4/c1-17(2)14-21(26-23(28)30-16-18-8-5-4-6-9-18)22(27)25-13-12-24-19-10-7-11-20(15-19)29-3/h4-11,15,17,21,24H,12-14,16H2,1-3H3,(H,25,27)(H,26,28)/t21-/m0/s1