N-[4-[(5-ethoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-methoxy-phenyl]pentanamide

Systemtic Name: N-[4-[(5-ethoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-methoxy-phenyl]pentanamide Openeye Name: N-[4-[(5-ethoxy-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-methoxy-phenyl]pentanamide CAS Name: N-[4-[(5-ethoxy-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-2-methoxyphenyl]pentanamide IUPAC Name: N-[4-[(5-ethoxy-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-2-methoxyphenyl]pentanamide Traditional Name: N-[4-[(5-ethoxy-6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-methoxy-phenyl]valeramide Formula: C21H25N3O6 MolecularWeight: 415.4397

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=C(C=C1)NC=C2C=C(C=C(C2=O)OCC)[N+](=O)[O-])OC

Isomeric SMILES

CCCCC(=O)NC1=C(C=C(C=C1)NC=C2C=C(C=C(C2=O)OCC)[N+](=O)[O-])OC

InChI

InChI=1S/C21H25N3O6/c1-4-6-7-20(25)23-17-9-8-15(11-18(17)29-3)22-13-14-10-16(24(27)28)12-19(21(14)26)30-5-2/h8-13,22H,4-7H2,1-3H3,(H,23,25)