(2S)-2-azanyl-N-[(6-methyl-4-oxidanylidene-chromen-3-yl)methylideneamino]-3-phenyl-propanamide hydrochloride

Systemtic Name: (2S)-2-azanyl-N-[(6-methyl-4-oxidanylidene-chromen-3-yl)methylideneamino]-3-phenyl-propanamide hydrochloride Openeye Name: (2S)-2-amino-N-[(6-methyl-4-oxo-chromen-3-yl)methyleneamino]-3-phenyl-propanamide hydrochloride CAS Name: (2S)-2-amino-N-[(6-methyl-4-oxo-1-benzopyran-3-yl)methylideneamino]-3-phenylpropanamide hydrochloride IUPAC Name: (2S)-2-amino-N-[(6-methyl-4-oxochromen-3-yl)methylideneamino]-3-phenylpropanamide hydrochloride Traditional Name: (2S)-2-amino-N-[(4-keto-6-methyl-chromen-3-yl)methyleneamino]-3-phenyl-propionamide hydrochloride Formula: C20H20ClN3O3 MolecularWeight: 385.8441

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC=C(C2=O)C=NNC(=O)C(CC3=CC=CC=C3)N.Cl

Isomeric SMILES

CC1=CC2=C(C=C1)OC=C(C2=O)C=NNC(=O)[C@H](CC3=CC=CC=C3)N.Cl

InChI

InChI=1S/C20H19N3O3.ClH/c1-13-7-8-18-16(9-13)19(24)15(12-26-18)11-22-23-20(25)17(21)10-14-5-3-2-4-6-14;/h2-9,11-12,17H,10,21H2,1H3,(H,23,25);1H/t17-;/m0./s1