N-[3-(azepin-1-yl)propyl]-3-(3-methoxyphenyl)-N-(naphthalen-1-ylmethyl)-1,2-oxazol-5-amine

Systemtic Name: N-[3-(azepin-1-yl)propyl]-3-(3-methoxyphenyl)-N-(naphthalen-1-ylmethyl)-1,2-oxazol-5-amine Openeye Name: N-[3-(azepin-1-yl)propyl]-3-(3-methoxyphenyl)-N-(1-naphthylmethyl)isoxazol-5-amine CAS Name: N-[3-(1-azepinyl)propyl]-3-(3-methoxyphenyl)-N-(1-naphthalenylmethyl)-5-isoxazolamine IUPAC Name: N-[3-(azepin-1-yl)propyl]-3-(3-methoxyphenyl)-N-(naphthalen-1-ylmethyl)-1,2-oxazol-5-amine Traditional Name: 3-(azepin-1-yl)propyl-[3-(3-methoxyphenyl)isoxazol-5-yl]-(1-naphthylmethyl)amine Formula: C30H29N3O2 MolecularWeight: 463.57016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NOC(=C2)N(CCCN3C=CC=CC=C3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

COC1=CC=CC(=C1)C2=NOC(=C2)N(CCCN3C=CC=CC=C3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C30H29N3O2/c1-34-27-15-9-13-25(21-27)29-22-30(35-31-29)33(20-10-19-32-17-6-2-3-7-18-32)23-26-14-8-12-24-11-4-5-16-28(24)26/h2-9,11-18,21-22H,10,19-20,23H2,1H3