(E)-2-ethyl-5-phenyl-2-piperazin-1-yl-1-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)pent-4-en-1-one

Systemtic Name: (E)-2-ethyl-5-phenyl-2-piperazin-1-yl-1-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)pent-4-en-1-one Openeye Name: (E)-2-ethyl-5-phenyl-2-piperazin-1-yl-1-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)pent-4-en-1-one CAS Name: (E)-2-ethyl-5-phenyl-2-(1-piperazinyl)-1-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-4-penten-1-one IUPAC Name: (E)-2-ethyl-5-phenyl-2-piperazin-1-yl-1-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)pent-4-en-1-one Traditional Name: (E)-2-ethyl-5-phenyl-2-piperazino-1-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)pent-4-en-1-one Formula: C27H35N3O MolecularWeight: 417.5863

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC=CC1=CC=CC=C1)(C(=O)C2=CC3=C(CCNCC3)C=C2)N4CCNCC4

Isomeric SMILES

CCC(C/C=C/C1=CC=CC=C1)(C(=O)C2=CC3=C(CCNCC3)C=C2)N4CCNCC4

InChI

InChI=1S/C27H35N3O/c1-2-27(30-19-17-29-18-20-30,14-6-9-22-7-4-3-5-8-22)26(31)25-11-10-23-12-15-28-16-13-24(23)21-25/h3-11,21,28-29H,2,12-20H2,1H3/b9-6+