N-(1,3-benzodioxol-5-ylmethyl)-N-[(5,8-dimethoxy-2-pyrrolidin-1-yl-quinolin-3-yl)methyl]-3-(3-methylpyrazol-1-yl)propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(5,8-dimethoxy-2-pyrrolidin-1-yl-quinolin-3-yl)methyl]-3-(3-methylpyrazol-1-yl)propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(5,8-dimethoxy-2-pyrrolidin-1-yl-3-quinolyl)methyl]-3-(3-methylpyrazol-1-yl)propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[[5,8-dimethoxy-2-(1-pyrrolidinyl)-3-quinolinyl]methyl]-3-(3-methyl-1-pyrazolyl)propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(5,8-dimethoxy-2-pyrrolidin-1-ylquinolin-3-yl)methyl]-3-(3-methylpyrazol-1-yl)propanamide Traditional Name: N-[(5,8-dimethoxy-2-pyrrolidino-3-quinolyl)methyl]-3-(3-methylpyrazol-1-yl)-N-piperonyl-propionamide Formula: C31H35N5O5 MolecularWeight: 557.6401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)CCC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC5=C(C=CC(=C5N=C4N6CCCC6)OC)OC

Isomeric SMILES

CC1=NN(C=C1)CCC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC5=C(C=CC(=C5N=C4N6CCCC6)OC)OC

InChI

InChI=1S/C31H35N5O5/c1-21-10-14-36(33-21)15-11-29(37)35(18-22-6-7-26-28(16-22)41-20-40-26)19-23-17-24-25(38-2)8-9-27(39-3)30(24)32-31(23)34-12-4-5-13-34/h6-10,14,16-17H,4-5,11-13,15,18-20H2,1-3H3