N-[(4-phenoxyphenyl)-phenyl-methyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine

Systemtic Name: N-[(4-phenoxyphenyl)-phenyl-methyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine Openeye Name: N-[(4-phenoxyphenyl)-phenyl-methyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine CAS Name: N-[(4-phenoxyphenyl)-phenylmethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine IUPAC Name: N-[(4-phenoxyphenyl)-phenylmethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine Traditional Name: [(4-phenoxyphenyl)-phenyl-methyl]-(3,4,5,6-tetrahydro-2H-azepin-7-yl)amine Formula: C25H26N2O MolecularWeight: 370.48674

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NCC1)NC(C2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CCC(=NCC1)NC(C2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H26N2O/c1-4-10-20(11-5-1)25(27-24-14-8-3-9-19-26-24)21-15-17-23(18-16-21)28-22-12-6-2-7-13-22/h1-2,4-7,10-13,15-18,25H,3,8-9,14,19H2,(H,26,27)