2-(1-methanoyl-9H-pyrido[3,4-b]indol-3-yl)ethyl (2S)-2-azanyl-3-phenyl-propanoate

Systemtic Name: 2-(1-methanoyl-9H-pyrido[3,4-b]indol-3-yl)ethyl (2S)-2-azanyl-3-phenyl-propanoate Openeye Name: 2-(1-formyl-9H-pyrido[3,4-b]indol-3-yl)ethyl (2S)-2-amino-3-phenyl-propanoate CAS Name: (2S)-2-amino-3-phenylpropanoic acid 2-(1-formyl-9H-pyrido[3,4-b]indol-3-yl)ethyl ester IUPAC Name: 2-(1-formyl-9H-pyrido[3,4-b]indol-3-yl)ethyl (2S)-2-amino-3-phenylpropanoate Traditional Name: (2S)-2-amino-3-phenyl-propionic acid 2-(1-formyl-9H-$b-carbolin-3-yl)ethyl ester Formula: C23H21N3O3 MolecularWeight: 387.43114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCCC2=NC(=C3C(=C2)C4=CC=CC=C4N3)C=O)N

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)OCCC2=NC(=C3C(=C2)C4=CC=CC=C4N3)C=O)N

InChI

InChI=1S/C23H21N3O3/c24-19(12-15-6-2-1-3-7-15)23(28)29-11-10-16-13-18-17-8-4-5-9-20(17)26-22(18)21(14-27)25-16/h1-9,13-14,19,26H,10-12,24H2/t19-/m0/s1