2-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]isoindole-1,3-dione

Systemtic Name: 2-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]isoindole-1,3-dione Openeye Name: 2-[(Z)-[4-(azepan-1-yl)phenyl]methyleneamino]isoindoline-1,3-dione CAS Name: 2-[(Z)-[4-(1-azepanyl)phenyl]methylideneamino]isoindole-1,3-dione IUPAC Name: 2-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]isoindole-1,3-dione Traditional Name: 2-[(Z)-[4-(azepan-1-yl)benzylidene]amino]isoindoline-1,3-quinone Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)C=NN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)/C=N\N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H21N3O2/c25-20-18-7-3-4-8-19(18)21(26)24(20)22-15-16-9-11-17(12-10-16)23-13-5-1-2-6-14-23/h3-4,7-12,15H,1-2,5-6,13-14H2/b22-15-