2-[ethyl-(phenylmethyl)amino]-1-(2,3,4,5-tetrahydro-1H-1-benzazepin-8-yl)heptan-1-one

Systemtic Name: 2-[ethyl-(phenylmethyl)amino]-1-(2,3,4,5-tetrahydro-1H-1-benzazepin-8-yl)heptan-1-one Openeye Name: 2-[benzyl(ethyl)amino]-1-(2,3,4,5-tetrahydro-1H-1-benzazepin-8-yl)heptan-1-one CAS Name: 2-[ethyl-(phenylmethyl)amino]-1-(2,3,4,5-tetrahydro-1H-1-benzazepin-8-yl)-1-heptanone IUPAC Name: 2-[benzyl(ethyl)amino]-1-(2,3,4,5-tetrahydro-1H-1-benzazepin-8-yl)heptan-1-one Traditional Name: 2-[benzyl(ethyl)amino]-1-(2,3,4,5-tetrahydro-1H-1-benzazepin-8-yl)heptan-1-one Formula: C26H36N2O MolecularWeight: 392.57684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=O)C1=CC2=C(CCCCN2)C=C1)N(CC)CC3=CC=CC=C3

Isomeric SMILES

CCCCCC(C(=O)C1=CC2=C(CCCCN2)C=C1)N(CC)CC3=CC=CC=C3

InChI

InChI=1S/C26H36N2O/c1-3-5-7-15-25(28(4-2)20-21-12-8-6-9-13-21)26(29)23-17-16-22-14-10-11-18-27-24(22)19-23/h6,8-9,12-13,16-17,19,25,27H,3-5,7,10-11,14-15,18,20H2,1-2H3