pyrrolidin-1-yl 3-(6-carbamimidoyl-1-methyl-indol-2-yl)-2-phenyl-butanoate

Systemtic Name: pyrrolidin-1-yl 3-(6-carbamimidoyl-1-methyl-indol-2-yl)-2-phenyl-butanoate Openeye Name: pyrrolidin-1-yl 3-(6-carbamimidoyl-1-methyl-indol-2-yl)-2-phenyl-butanoate CAS Name: 3-(6-carbamimidoyl-1-methyl-2-indolyl)-2-phenylbutanoic acid 1-pyrrolidinyl ester IUPAC Name: pyrrolidin-1-yl 3-(6-carbamimidoyl-1-methylindol-2-yl)-2-phenylbutanoate Traditional Name: 3-(6-amidino-1-methyl-indol-2-yl)-2-phenyl-butyric acid pyrrolidino ester Formula: C24H28N4O2 MolecularWeight: 404.50472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(N1C)C=C(C=C2)C(=N)N)C(C3=CC=CC=C3)C(=O)ON4CCCC4

Isomeric SMILES

CC(C1=CC2=C(N1C)C=C(C=C2)C(=N)N)C(C3=CC=CC=C3)C(=O)ON4CCCC4

InChI

InChI=1S/C24H28N4O2/c1-16(20-14-18-10-11-19(23(25)26)15-21(18)27(20)2)22(17-8-4-3-5-9-17)24(29)30-28-12-6-7-13-28/h3-5,8-11,14-16,22H,6-7,12-13H2,1-2H3,(H3,25,26)