N-[1-[4-(3-phenoxypropoxy)phenyl]ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine

Systemtic Name: N-[1-[4-(3-phenoxypropoxy)phenyl]ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine Openeye Name: N-[1-[4-(3-phenoxypropoxy)phenyl]ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine CAS Name: N-[1-[4-(3-phenoxypropoxy)phenyl]ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine IUPAC Name: N-[1-[4-(3-phenoxypropoxy)phenyl]ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine Traditional Name: 1-[4-(3-phenoxypropoxy)phenyl]ethyl-(3,4,5,6-tetrahydro-2H-azepin-7-yl)amine Formula: C23H30N2O2 MolecularWeight: 366.4965

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OCCCOC2=CC=CC=C2)NC3=NCCCCC3

Isomeric SMILES

CC(C1=CC=C(C=C1)OCCCOC2=CC=CC=C2)NC3=NCCCCC3

InChI

InChI=1S/C23H30N2O2/c1-19(25-23-11-6-3-7-16-24-23)20-12-14-22(15-13-20)27-18-8-17-26-21-9-4-2-5-10-21/h2,4-5,9-10,12-15,19H,3,6-8,11,16-18H2,1H3,(H,24,25)