(4E)-4-(7-chloranyl-1H-quinolin-4-ylidene)-2-[(3-imidazol-1-ylpropylamino)methyl]cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-4-(7-chloranyl-1H-quinolin-4-ylidene)-2-[(3-imidazol-1-ylpropylamino)methyl]cyclohexa-2,5-dien-1-one Openeye Name: (4E)-4-(7-chloro-1H-quinolin-4-ylidene)-2-[(3-imidazol-1-ylpropylamino)methyl]cyclohexa-2,5-dien-1-one CAS Name: (4E)-4-(7-chloro-1H-quinolin-4-ylidene)-2-[[3-(1-imidazolyl)propylamino]methyl]-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-4-(7-chloro-1H-quinolin-4-ylidene)-2-[(3-imidazol-1-ylpropylamino)methyl]cyclohexa-2,5-dien-1-one Traditional Name: (4E)-4-(7-chloro-1H-quinolin-4-ylidene)-2-[(3-imidazol-1-ylpropylamino)methyl]cyclohexa-2,5-dien-1-one Formula: C22H21ClN4O MolecularWeight: 392.88134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)NC=CC2=C3C=CC(=O)C(=C3)CNCCCN4C=CN=C4

Isomeric SMILES

C1=CC\2=C(C=C1Cl)NC=C/C2=C\3/C=CC(=O)C(=C3)CNCCCN4C=CN=C4

InChI

InChI=1S/C22H21ClN4O/c23-18-3-4-20-19(6-8-26-21(20)13-18)16-2-5-22(28)17(12-16)14-24-7-1-10-27-11-9-25-15-27/h2-6,8-9,11-13,15,24,26H,1,7,10,14H2/b19-16+