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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCNCC1CN(C2=CC=CC=C2O1)CC3=CC=CC=C3)C4=CNC5=CC=CC=C54

Isomeric SMILES

CC(CCNCC1CN(C2=CC=CC=C2O1)CC3=CC=CC=C3)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C28H31N3O/c1-21(25-18-30-26-12-6-5-11-24(25)26)15-16-29-17-23-20-31(19-22-9-3-2-4-10-22)27-13-7-8-14-28(27)32-23/h2-14,18,21,23,29-30H,15-17,19-20H2,1H3