(2Z)-N-(2-methylpropyl)-4-(naphthalen-1-ylmethyl)-2-(3-phenyl-2H-1,2-oxazol-5-ylidene)azepin-3-amine

Systemtic Name: (2Z)-N-(2-methylpropyl)-4-(naphthalen-1-ylmethyl)-2-(3-phenyl-2H-1,2-oxazol-5-ylidene)azepin-3-amine Openeye Name: (2Z)-N-isobutyl-4-(1-naphthylmethyl)-2-(3-phenyl-2H-isoxazol-5-ylidene)azepin-3-amine CAS Name: (2Z)-N-(2-methylpropyl)-4-(1-naphthalenylmethyl)-2-(3-phenyl-2H-isoxazol-5-ylidene)-3-azepinamine IUPAC Name: (2Z)-N-(2-methylpropyl)-4-(naphthalen-1-ylmethyl)-2-(3-phenyl-2H-1,2-oxazol-5-ylidene)azepin-3-amine Traditional Name: isobutyl-[(2Z)-4-(1-naphthylmethyl)-2-(3-phenyl-3-isoxazolin-5-ylidene)azepin-3-yl]amine Formula: C30H29N3O MolecularWeight: 447.57076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=C(C=CC=NC1=C2C=C(NO2)C3=CC=CC=C3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC(C)CNC\1=C(C=CC=N/C1=C\2/C=C(NO2)C3=CC=CC=C3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C30H29N3O/c1-21(2)20-32-29-25(18-24-14-8-13-22-10-6-7-16-26(22)24)15-9-17-31-30(29)28-19-27(33-34-28)23-11-4-3-5-12-23/h3-17,19,21,32-33H,18,20H2,1-2H3/b30-28-