(1-methanoyl-4a,9-dihydropyrido[3,4-b]indol-2-yl) (2S)-2-azanyl-3-phenyl-propanoate

Systemtic Name: (1-methanoyl-4a,9-dihydropyrido[3,4-b]indol-2-yl) (2S)-2-azanyl-3-phenyl-propanoate Openeye Name: (1-formyl-4a,9-dihydropyrido[3,4-b]indol-2-yl) (2S)-2-amino-3-phenyl-propanoate CAS Name: (2S)-2-amino-3-phenylpropanoic acid (1-formyl-4a,9-dihydropyrido[3,4-b]indol-2-yl) ester IUPAC Name: (1-formyl-4a,9-dihydropyrido[3,4-b]indol-2-yl) (2S)-2-amino-3-phenylpropanoate Traditional Name: (2S)-2-amino-3-phenyl-propionic acid (1-formyl-4a,9-dihydro-$b-carbolin-2-yl) ester Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)ON2C=CC3C4=CC=CC=C4NC3=C2C=O)N

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)ON2C=CC3C4=CC=CC=C4NC3=C2C=O)N

InChI

InChI=1S/C21H19N3O3/c22-17(12-14-6-2-1-3-7-14)21(26)27-24-11-10-16-15-8-4-5-9-18(15)23-20(16)19(24)13-25/h1-11,13,16-17,23H,12,22H2/t16?,17-/m0/s1