(4S)-2-(3-methoxyphenyl)-4-(3-morpholin-4-ylpropyliminomethyl)-4H-isoquinoline-1,3-dione

Systemtic Name: (4S)-2-(3-methoxyphenyl)-4-(3-morpholin-4-ylpropyliminomethyl)-4H-isoquinoline-1,3-dione Openeye Name: (4S)-2-(3-methoxyphenyl)-4-(3-morpholinopropyliminomethyl)-4H-isoquinoline-1,3-dione CAS Name: (4S)-2-(3-methoxyphenyl)-4-[3-(4-morpholinyl)propyliminomethyl]-4H-isoquinoline-1,3-dione IUPAC Name: (4S)-2-(3-methoxyphenyl)-4-(3-morpholin-4-ylpropyliminomethyl)-4H-isoquinoline-1,3-dione Traditional Name: (4S)-2-(3-methoxyphenyl)-4-(3-morpholinopropyliminomethyl)-4H-isoquinoline-1,3-quinone Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=O)C(C3=CC=CC=C3C2=O)C=NCCCN4CCOCC4

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=O)[C@@H](C3=CC=CC=C3C2=O)C=NCCCN4CCOCC4

InChI

InChI=1S/C24H27N3O4/c1-30-19-7-4-6-18(16-19)27-23(28)21-9-3-2-8-20(21)22(24(27)29)17-25-10-5-11-26-12-14-31-15-13-26/h2-4,6-9,16-17,22H,5,10-15H2,1H3/t22-/m1/s1