ethyl 3-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]butyl]-1H-indole-5-carboxylate

Systemtic Name: ethyl 3-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]butyl]-1H-indole-5-carboxylate Openeye Name: ethyl 3-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]butyl]-1H-indole-5-carboxylate CAS Name: 3-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-piperazinyl]butyl]-1H-indole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]butyl]-1H-indole-5-carboxylate Traditional Name: 3-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazino]butyl]-1H-indole-5-carboxylic acid ethyl ester Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)NC=C2CCCCN3CCN(CC3)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)NC=C2CCCCN3CCN(CC3)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C27H33N3O4/c1-2-32-27(31)20-6-8-24-23(17-20)21(19-28-24)5-3-4-10-29-11-13-30(14-12-29)22-7-9-25-26(18-22)34-16-15-33-25/h6-9,17-19,28H,2-5,10-16H2,1H3