2-[(3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-6-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[(3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-6-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[(3,5-dimethyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-[(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-[(4-keto-3,5-dimethyl-cyclohexa-2,5-dien-1-ylidene)methylamino]-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C21H15N3O5 MolecularWeight: 389.3609

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNN2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O)C=C(C1=O)C

Isomeric SMILES

CC1=CC(=CNN2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O)C=C(C1=O)C

InChI

InChI=1S/C21H15N3O5/c1-11-8-13(9-12(2)19(11)25)10-22-23-20(26)15-5-3-4-14-17(24(28)29)7-6-16(18(14)15)21(23)27/h3-10,22H,1-2H3