1-cyano-3-[1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-yl]-2-(2,2-dimethoxyethyl)guanidine

Systemtic Name: 1-cyano-3-[1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-yl]-2-(2,2-dimethoxyethyl)guanidine Openeye Name: 1-[1-(chroman-2-ylmethyl)-4-piperidyl]-3-cyano-2-(2,2-dimethoxyethyl)guanidine CAS Name: 1-cyano-3-[1-(3,4-dihydro-2H-1-benzopyran-2-ylmethyl)-4-piperidinyl]-2-(2,2-dimethoxyethyl)guanidine IUPAC Name: 1-cyano-3-[1-(3,4-dihydro-2H-chromen-2-ylmethyl)piperidin-4-yl]-2-(2,2-dimethoxyethyl)guanidine Traditional Name: 1-[1-(chroman-2-ylmethyl)-4-piperidyl]-3-cyano-2-(2,2-dimethoxyethyl)guanidine Formula: C21H31N5O3 MolecularWeight: 401.50254

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Descriptors Computed from Structure

Canonical SMILES:

COC(CN=C(NC#N)NC1CCN(CC1)CC2CCC3=CC=CC=C3O2)OC

Isomeric SMILES

COC(CN=C(NC#N)NC1CCN(CC1)CC2CCC3=CC=CC=C3O2)OC

InChI

InChI=1S/C21H31N5O3/c1-27-20(28-2)13-23-21(24-15-22)25-17-9-11-26(12-10-17)14-18-8-7-16-5-3-4-6-19(16)29-18/h3-6,17-18,20H,7-14H2,1-2H3,(H2,23,24,25)