[4-[(2-carbamimidoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]-1-pyridin-4-yl-piperidin-4-yl] ethyl carbonate

Systemtic Name: [4-[(2-carbamimidoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]-1-pyridin-4-yl-piperidin-4-yl] ethyl carbonate Openeye Name: [4-[(2-carbamimidoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]-1-(4-pyridyl)-4-piperidyl] ethyl carbonate CAS Name: carbonic acid [4-[(2-carbamimidoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]-1-pyridin-4-yl-4-piperidinyl] ethyl ester IUPAC Name: [4-[(2-carbamimidoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]-1-pyridin-4-ylpiperidin-4-yl] ethyl carbonate Traditional Name: carbonic acid [4-[(2-amidino-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]-1-(4-pyridyl)-4-piperidyl] ethyl ester Formula: C24H31N5O4 MolecularWeight: 453.53404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC1(CCN(CC1)C2=CC=NC=C2)COC3=CC4=C(CCN(C4)C(=N)N)C=C3

Isomeric SMILES

CCOC(=O)OC1(CCN(CC1)C2=CC=NC=C2)COC3=CC4=C(CCN(C4)C(=N)N)C=C3

InChI

InChI=1S/C24H31N5O4/c1-2-31-23(30)33-24(8-13-28(14-9-24)20-5-10-27-11-6-20)17-32-21-4-3-18-7-12-29(22(25)26)16-19(18)15-21/h3-6,10-11,15H,2,7-9,12-14,16-17H2,1H3,(H3,25,26)