4-[4-[4-(5-chloranyl-1H-indol-3-yl)piperidin-1-yl]butyl]-3,4-dihydro-2H-1,2-benzoxazine

Systemtic Name: 4-[4-[4-(5-chloranyl-1H-indol-3-yl)piperidin-1-yl]butyl]-3,4-dihydro-2H-1,2-benzoxazine Openeye Name: 4-[4-[4-(5-chloro-1H-indol-3-yl)-1-piperidyl]butyl]-3,4-dihydro-2H-1,2-benzoxazine CAS Name: 4-[4-[4-(5-chloro-1H-indol-3-yl)-1-piperidinyl]butyl]-3,4-dihydro-2H-1,2-benzoxazine IUPAC Name: 4-[4-[4-(5-chloro-1H-indol-3-yl)piperidin-1-yl]butyl]-3,4-dihydro-2H-1,2-benzoxazine Traditional Name: 4-[4-[4-(5-chloro-1H-indol-3-yl)piperidino]butyl]-3,4-dihydro-2H-1,2-benzoxazine Formula: C25H30ClN3O MolecularWeight: 423.9782

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CNC3=C2C=C(C=C3)Cl)CCCCC4CNOC5=CC=CC=C45

Isomeric SMILES

C1CN(CCC1C2=CNC3=C2C=C(C=C3)Cl)CCCCC4CNOC5=CC=CC=C45

InChI

InChI=1S/C25H30ClN3O/c26-20-8-9-24-22(15-20)23(17-27-24)18-10-13-29(14-11-18)12-4-3-5-19-16-28-30-25-7-2-1-6-21(19)25/h1-2,6-9,15,17-19,27-28H,3-5,10-14,16H2