4-[(E)-3-[1-(1,3-benzodioxol-5-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-3-oxidanylidene-prop-1-enyl]-N-(oxolan-2-ylmethyl)benzamide

Systemtic Name: 4-[(E)-3-[1-(1,3-benzodioxol-5-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-3-oxidanylidene-prop-1-enyl]-N-(oxolan-2-ylmethyl)benzamide Openeye Name: 4-[(E)-3-[1-(1,3-benzodioxol-5-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-3-oxo-prop-1-enyl]-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 4-[(E)-3-[1-(1,3-benzodioxol-5-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-3-oxoprop-1-enyl]-N-(2-oxolanylmethyl)benzamide IUPAC Name: 4-[(E)-3-[1-(1,3-benzodioxol-5-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-3-oxoprop-1-enyl]-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 4-[(E)-3-[1-(1,3-benzodioxol-5-yl)-1,3,4,9-tetrahydro-$b-carbolin-2-yl]-3-keto-prop-1-enyl]-N-(tetrahydrofurfuryl)benzamide Formula: C33H31N3O5 MolecularWeight: 549.61634

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=CC=C(C=C2)C=CC(=O)N3CCC4=C(C3C5=CC6=C(C=C5)OCO6)NC7=CC=CC=C47

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=CC=C(C=C2)/C=C/C(=O)N3CCC4=C(C3C5=CC6=C(C=C5)OCO6)NC7=CC=CC=C47

InChI

InChI=1S/C33H31N3O5/c37-30(14-9-21-7-10-22(11-8-21)33(38)34-19-24-4-3-17-39-24)36-16-15-26-25-5-1-2-6-27(25)35-31(26)32(36)23-12-13-28-29(18-23)41-20-40-28/h1-2,5-14,18,24,32,35H,3-4,15-17,19-20H2,(H,34,38)/b14-9+