(4Z)-2-(3-methylphenyl)-4-[(4-morpholin-4-yl-3-nitro-phenyl)methylidene]isoquinoline-1,3-dione

Systemtic Name: (4Z)-2-(3-methylphenyl)-4-[(4-morpholin-4-yl-3-nitro-phenyl)methylidene]isoquinoline-1,3-dione Openeye Name: (4Z)-4-[(4-morpholino-3-nitro-phenyl)methylene]-2-(m-tolyl)isoquinoline-1,3-dione CAS Name: (4Z)-2-(3-methylphenyl)-4-[[4-(4-morpholinyl)-3-nitrophenyl]methylidene]isoquinoline-1,3-dione IUPAC Name: (4Z)-2-(3-methylphenyl)-4-[(4-morpholin-4-yl-3-nitrophenyl)methylidene]isoquinoline-1,3-dione Traditional Name: (4Z)-4-(4-morpholino-3-nitro-benzylidene)-2-(m-tolyl)isoquinoline-1,3-quinone Formula: C27H23N3O5 MolecularWeight: 469.48862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3C(=CC4=CC(=C(C=C4)N5CCOCC5)[N+](=O)[O-])C2=O

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3/C(=C/C4=CC(=C(C=C4)N5CCOCC5)[N+](=O)[O-])/C2=O

InChI

InChI=1S/C27H23N3O5/c1-18-5-4-6-20(15-18)29-26(31)22-8-3-2-7-21(22)23(27(29)32)16-19-9-10-24(25(17-19)30(33)34)28-11-13-35-14-12-28/h2-10,15-17H,11-14H2,1H3/b23-16-