1-methyl-2-oxidanyl-3-[3-[(phenylmethyl)amino]but-2-enoyl]quinolin-4-one

Systemtic Name: 1-methyl-2-oxidanyl-3-[3-[(phenylmethyl)amino]but-2-enoyl]quinolin-4-one Openeye Name: 3-[3-(benzylamino)but-2-enoyl]-2-hydroxy-1-methyl-quinolin-4-one CAS Name: 2-hydroxy-1-methyl-3-[1-oxo-3-[(phenylmethyl)amino]but-2-enyl]-4-quinolinone IUPAC Name: 3-[3-(benzylamino)but-2-enoyl]-2-hydroxy-1-methylquinolin-4-one Traditional Name: 3-[3-(benzylamino)but-2-enoyl]-2-hydroxy-1-methyl-4-quinolone Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C1=C(N(C2=CC=CC=C2C1=O)C)O)NCC3=CC=CC=C3

Isomeric SMILES

CC(=CC(=O)C1=C(N(C2=CC=CC=C2C1=O)C)O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O3/c1-14(22-13-15-8-4-3-5-9-15)12-18(24)19-20(25)16-10-6-7-11-17(16)23(2)21(19)26/h3-12,22,26H,13H2,1-2H3