N-[3-(azepin-1-yl)propyl]-3-(4-methoxyphenyl)-N-(naphthalen-1-ylmethyl)-1,2-oxazol-5-amine

Systemtic Name: N-[3-(azepin-1-yl)propyl]-3-(4-methoxyphenyl)-N-(naphthalen-1-ylmethyl)-1,2-oxazol-5-amine Openeye Name: N-[3-(azepin-1-yl)propyl]-3-(4-methoxyphenyl)-N-(1-naphthylmethyl)isoxazol-5-amine CAS Name: N-[3-(1-azepinyl)propyl]-3-(4-methoxyphenyl)-N-(1-naphthalenylmethyl)-5-isoxazolamine IUPAC Name: N-[3-(azepin-1-yl)propyl]-3-(4-methoxyphenyl)-N-(naphthalen-1-ylmethyl)-1,2-oxazol-5-amine Traditional Name: 3-(azepin-1-yl)propyl-[3-(4-methoxyphenyl)isoxazol-5-yl]-(1-naphthylmethyl)amine Formula: C30H29N3O2 MolecularWeight: 463.57016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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