(E)-N-[4-(1-phenyl-1,2,4,9a-tetrahydro-3-benzazepin-3-yl)butyl]-3-pyridin-3-yl-prop-2-enamide

Systemtic Name: (E)-N-[4-(1-phenyl-1,2,4,9a-tetrahydro-3-benzazepin-3-yl)butyl]-3-pyridin-3-yl-prop-2-enamide Openeye Name: (E)-N-[4-(1-phenyl-1,2,4,9a-tetrahydro-3-benzazepin-3-yl)butyl]-3-(3-pyridyl)prop-2-enamide CAS Name: (E)-N-[4-(1-phenyl-1,2,4,9a-tetrahydro-3-benzazepin-3-yl)butyl]-3-(3-pyridinyl)-2-propenamide IUPAC Name: (E)-N-[4-(1-phenyl-1,2,4,9a-tetrahydro-3-benzazepin-3-yl)butyl]-3-pyridin-3-ylprop-2-enamide Traditional Name: (E)-N-[4-(1-phenyl-1,2,4,9a-tetrahydro-3-benzazepin-3-yl)butyl]-3-(3-pyridyl)acrylamide Formula: C28H31N3O MolecularWeight: 425.56524

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C2C=CC=CC2C(CN1CCCCNC(=O)C=CC3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C=C2C=CC=CC2C(CN1CCCCNC(=O)/C=C/C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H31N3O/c32-28(15-14-23-9-8-17-29-21-23)30-18-6-7-19-31-20-16-25-12-4-5-13-26(25)27(22-31)24-10-2-1-3-11-24/h1-5,8-17,21,26-27H,6-7,18-20,22H2,(H,30,32)/b15-14+