ethyl 1-[3-(1,3-benzodioxol-5-yl)-3-(1-ethylindol-3-yl)propanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-(1,3-benzodioxol-5-yl)-3-(1-ethylindol-3-yl)propanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-(1,3-benzodioxol-5-yl)-3-(1-ethylindol-3-yl)propanoyl]piperidine-3-carboxylate CAS Name: 1-[3-(1,3-benzodioxol-5-yl)-3-(1-ethyl-3-indolyl)-1-oxopropyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(1,3-benzodioxol-5-yl)-3-(1-ethylindol-3-yl)propanoyl]piperidine-3-carboxylate Traditional Name: 1-[3-(1,3-benzodioxol-5-yl)-3-(1-ethylindol-3-yl)propanoyl]nipecotic acid ethyl ester Formula: C28H32N2O5 MolecularWeight: 476.56408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C(CC(=O)N3CCCC(C3)C(=O)OCC)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)C(CC(=O)N3CCCC(C3)C(=O)OCC)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H32N2O5/c1-3-29-17-23(21-9-5-6-10-24(21)29)22(19-11-12-25-26(14-19)35-18-34-25)15-27(31)30-13-7-8-20(16-30)28(32)33-4-2/h5-6,9-12,14,17,20,22H,3-4,7-8,13,15-16,18H2,1-2H3