(2S)-2-azanyl-3-(1H-indol-3-yl)-N-(4-methyl-2-oxidanylidene-chromen-7-yl)propanamide hydrochloride

Systemtic Name: (2S)-2-azanyl-3-(1H-indol-3-yl)-N-(4-methyl-2-oxidanylidene-chromen-7-yl)propanamide hydrochloride Openeye Name: (2S)-2-amino-3-(1H-indol-3-yl)-N-(4-methyl-2-oxo-chromen-7-yl)propanamide hydrochloride CAS Name: (2S)-2-amino-3-(1H-indol-3-yl)-N-(4-methyl-2-oxo-1-benzopyran-7-yl)propanamide hydrochloride IUPAC Name: (2S)-2-amino-3-(1H-indol-3-yl)-N-(4-methyl-2-oxochromen-7-yl)propanamide hydrochloride Traditional Name: (2S)-2-amino-3-(1H-indol-3-yl)-N-(2-keto-4-methyl-chromen-7-yl)propionamide hydrochloride Formula: C21H20ClN3O3 MolecularWeight: 397.8548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(CC3=CNC4=CC=CC=C43)N.Cl

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)N.Cl

InChI

InChI=1S/C21H19N3O3.ClH/c1-12-8-20(25)27-19-10-14(6-7-15(12)19)24-21(26)17(22)9-13-11-23-18-5-3-2-4-16(13)18;/h2-8,10-11,17,23H,9,22H2,1H3,(H,24,26);1H/t17-;/m0./s1