N-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-4-nitro-benzamide

Systemtic Name: N-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-4-nitro-benzamide Openeye Name: N-[(Z)-[4-(azepan-1-yl)phenyl]methyleneamino]-4-nitro-benzamide CAS Name: N-[(Z)-[4-(1-azepanyl)phenyl]methylideneamino]-4-nitrobenzamide IUPAC Name: N-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-4-nitrobenzamide Traditional Name: N-[(Z)-[4-(azepan-1-yl)benzylidene]amino]-4-nitro-benzamide Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)C=NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)/C=N\NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O3/c25-20(17-7-11-19(12-8-17)24(26)27)22-21-15-16-5-9-18(10-6-16)23-13-3-1-2-4-14-23/h5-12,15H,1-4,13-14H2,(H,22,25)/b21-15-