ethyl 1-(3-methylbutyl)-5-(quinoxalin-5-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate

Systemtic Name: ethyl 1-(3-methylbutyl)-5-(quinoxalin-5-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate Openeye Name: ethyl 1-isopentyl-5-(quinoxalin-5-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate CAS Name: 1-(3-methylbutyl)-5-(5-quinoxalinylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-methylbutyl)-5-(quinoxalin-5-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate Traditional Name: 1-isoamyl-5-(quinoxalin-5-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid ethyl ester Formula: C23H29N5O2 MolecularWeight: 407.50866

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1CN(CC2)CC3=C4C(=CC=C3)N=CC=N4)CCC(C)C

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1CN(CC2)CC3=C4C(=CC=C3)N=CC=N4)CCC(C)C

InChI

InChI=1S/C23H29N5O2/c1-4-30-23(29)22-18-15-27(12-9-20(18)28(26-22)13-8-16(2)3)14-17-6-5-7-19-21(17)25-11-10-24-19/h5-7,10-11,16H,4,8-9,12-15H2,1-3H3