4-(1H-indol-3-yl)-N-[[4-(phenylmethyl)-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]butan-1-amine

Systemtic Name: 4-(1H-indol-3-yl)-N-[[4-(phenylmethyl)-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]butan-1-amine Openeye Name: N-[(4-benzyl-2,3-dihydro-1,4-benzoxazin-2-yl)methyl]-4-(1H-indol-3-yl)butan-1-amine CAS Name: 4-(1H-indol-3-yl)-N-[[4-(phenylmethyl)-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-1-butanamine IUPAC Name: N-[(4-benzyl-2,3-dihydro-1,4-benzoxazin-2-yl)methyl]-4-(1H-indol-3-yl)butan-1-amine Traditional Name: (4-benzyl-2,3-dihydro-1,4-benzoxazin-2-yl)methyl-[4-(1H-indol-3-yl)butyl]amine Formula: C28H31N3O MolecularWeight: 425.56524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2N1CC3=CC=CC=C3)CNCCCCC4=CNC5=CC=CC=C54

Isomeric SMILES

C1C(OC2=CC=CC=C2N1CC3=CC=CC=C3)CNCCCCC4=CNC5=CC=CC=C54

InChI

InChI=1S/C28H31N3O/c1-2-10-22(11-3-1)20-31-21-24(32-28-16-7-6-15-27(28)31)19-29-17-9-8-12-23-18-30-26-14-5-4-13-25(23)26/h1-7,10-11,13-16,18,24,29-30H,8-9,12,17,19-21H2