[3-(phenylmethyl)-1H-pyrrol-2-yl]methyl 3-methyl-2-phenylazanyl-butanoate

Systemtic Name: [3-(phenylmethyl)-1H-pyrrol-2-yl]methyl 3-methyl-2-phenylazanyl-butanoate Openeye Name: (3-benzyl-1H-pyrrol-2-yl)methyl 2-anilino-3-methyl-butanoate CAS Name: 2-anilino-3-methylbutanoic acid [3-(phenylmethyl)-1H-pyrrol-2-yl]methyl ester IUPAC Name: (3-benzyl-1H-pyrrol-2-yl)methyl 2-anilino-3-methylbutanoate Traditional Name: 2-anilino-3-methyl-butyric acid (3-benzyl-1H-pyrrol-2-yl)methyl ester Formula: C23H26N2O2 MolecularWeight: 362.46474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=C(C=CN1)CC2=CC=CC=C2)NC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)OCC1=C(C=CN1)CC2=CC=CC=C2)NC3=CC=CC=C3

InChI

InChI=1S/C23H26N2O2/c1-17(2)22(25-20-11-7-4-8-12-20)23(26)27-16-21-19(13-14-24-21)15-18-9-5-3-6-10-18/h3-14,17,22,24-25H,15-16H2,1-2H3