6-(4-methoxyphenyl)-N-[3-(pyrrolidin-1-ylmethyl)-2H-chromen-7-yl]pyridine-3-carboxamide

Systemtic Name: 6-(4-methoxyphenyl)-N-[3-(pyrrolidin-1-ylmethyl)-2H-chromen-7-yl]pyridine-3-carboxamide Openeye Name: 6-(4-methoxyphenyl)-N-[3-(pyrrolidin-1-ylmethyl)-2H-chromen-7-yl]pyridine-3-carboxamide CAS Name: 6-(4-methoxyphenyl)-N-[3-(1-pyrrolidinylmethyl)-2H-1-benzopyran-7-yl]-3-pyridinecarboxamide IUPAC Name: 6-(4-methoxyphenyl)-N-[3-(pyrrolidin-1-ylmethyl)-2H-chromen-7-yl]pyridine-3-carboxamide Traditional Name: 6-(4-methoxyphenyl)-N-[3-(pyrrolidinomethyl)-2H-chromen-7-yl]nicotinamide Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC=C(C=C2)C(=O)NC3=CC4=C(C=C3)C=C(CO4)CN5CCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC=C(C=C2)C(=O)NC3=CC4=C(C=C3)C=C(CO4)CN5CCCC5

InChI

InChI=1S/C27H27N3O3/c1-32-24-9-5-20(6-10-24)25-11-7-22(16-28-25)27(31)29-23-8-4-21-14-19(18-33-26(21)15-23)17-30-12-2-3-13-30/h4-11,14-16H,2-3,12-13,17-18H2,1H3,(H,29,31)