ethyl 1-[(2R)-2-azanyl-3-(1H-indol-3-yl)propanoyl]-3-(phenylmethyl)pyrrolidine-3-carboxylate

Systemtic Name: ethyl 1-[(2R)-2-azanyl-3-(1H-indol-3-yl)propanoyl]-3-(phenylmethyl)pyrrolidine-3-carboxylate Openeye Name: ethyl 1-[(2R)-2-amino-3-(1H-indol-3-yl)propanoyl]-3-benzyl-pyrrolidine-3-carboxylate CAS Name: 1-[(2R)-2-amino-3-(1H-indol-3-yl)-1-oxopropyl]-3-(phenylmethyl)-3-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2R)-2-amino-3-(1H-indol-3-yl)propanoyl]-3-benzylpyrrolidine-3-carboxylate Traditional Name: 1-[(2R)-2-amino-3-(1H-indol-3-yl)propanoyl]-3-benzyl-pyrrolidine-3-carboxylic acid ethyl ester Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(C1)C(=O)C(CC2=CNC3=CC=CC=C32)N)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCN(C1)C(=O)[C@@H](CC2=CNC3=CC=CC=C32)N)CC4=CC=CC=C4

InChI

InChI=1S/C25H29N3O3/c1-2-31-24(30)25(15-18-8-4-3-5-9-18)12-13-28(17-25)23(29)21(26)14-19-16-27-22-11-7-6-10-20(19)22/h3-11,16,21,27H,2,12-15,17,26H2,1H3/t21-,25?/m1/s1