4-chloranyl-6-[(2S)-2-methyl-5-phenyl-1,2,3,6-tetrahydro-1,4-diazepin-7-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-chloranyl-6-[(2S)-2-methyl-5-phenyl-1,2,3,6-tetrahydro-1,4-diazepin-7-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-chloro-6-[(2S)-2-methyl-5-phenyl-1,2,3,6-tetrahydro-1,4-diazepin-7-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 4-chloro-6-[(2S)-2-methyl-5-phenyl-1,2,3,6-tetrahydro-1,4-diazepin-7-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-chloro-6-[(2S)-2-methyl-5-phenyl-1,2,3,6-tetrahydro-1,4-diazepin-7-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-chloro-6-[(2S)-2-methyl-5-phenyl-1,2,3,6-tetrahydro-1,4-diazepin-7-ylidene]cyclohexa-2,4-dien-1-one Formula: C18H17ClN2O MolecularWeight: 312.79338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN=C(CC(=C2C=C(C=CC2=O)Cl)N1)C3=CC=CC=C3

Isomeric SMILES

C[C@H]1CN=C(CC(=C2C=C(C=CC2=O)Cl)N1)C3=CC=CC=C3

InChI

InChI=1S/C18H17ClN2O/c1-12-11-20-16(13-5-3-2-4-6-13)10-17(21-12)15-9-14(19)7-8-18(15)22/h2-9,12,21H,10-11H2,1H3/t12-/m0/s1