7-chloranyl-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1-pentyl-3-propan-2-yl-3,4-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1-pentyl-3-propan-2-yl-3,4-dihydro-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-3-isopropyl-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1-pentyl-3,4-dihydro-1,4-benzodiazepin-2-one CAS Name: 7-chloro-5-(4-oxo-1-cyclohexa-2,5-dienylidene)-1-pentyl-3-propan-2-yl-3,4-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1-pentyl-3-propan-2-yl-3,4-dihydro-1,4-benzodiazepin-2-one Traditional Name: 1-amyl-7-chloro-3-isopropyl-5-(4-ketocyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1,4-benzodiazepin-2-one Formula: C23H27ClN2O2 MolecularWeight: 398.92568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(C=C(C=C2)Cl)C(=C3C=CC(=O)C=C3)NC(C1=O)C(C)C

Isomeric SMILES

CCCCCN1C2=C(C=C(C=C2)Cl)C(=C3C=CC(=O)C=C3)NC(C1=O)C(C)C

InChI

InChI=1S/C23H27ClN2O2/c1-4-5-6-13-26-20-12-9-17(24)14-19(20)22(16-7-10-18(27)11-8-16)25-21(15(2)3)23(26)28/h7-12,14-15,21,25H,4-6,13H2,1-3H3