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

Systemtic Name: 4-(1H-indol-3-yl)-1-[4-(phenylmethyl)-2,3-dihydro-1,4-benzoxazin-2-yl]butan-2-amine Openeye Name: 1-(4-benzyl-2,3-dihydro-1,4-benzoxazin-2-yl)-4-(1H-indol-3-yl)butan-2-amine CAS Name: 4-(1H-indol-3-yl)-1-[4-(phenylmethyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-2-butanamine IUPAC Name: 1-(4-benzyl-2,3-dihydro-1,4-benzoxazin-2-yl)-4-(1H-indol-3-yl)butan-2-amine Traditional Name: [1-[(4-benzyl-2,3-dihydro-1,4-benzoxazin-2-yl)methyl]-3-(1H-indol-3-yl)propyl]amine Formula: C27H29N3O MolecularWeight: 411.53866

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2N1CC3=CC=CC=C3)CC(CCC4=CNC5=CC=CC=C54)N

Isomeric SMILES

C1C(OC2=CC=CC=C2N1CC3=CC=CC=C3)CC(CCC4=CNC5=CC=CC=C54)N

InChI

InChI=1S/C27H29N3O/c28-22(15-14-21-17-29-25-11-5-4-10-24(21)25)16-23-19-30(18-20-8-2-1-3-9-20)26-12-6-7-13-27(26)31-23/h1-13,17,22-23,29H,14-16,18-19,28H2