4-[2-(3,4-dimethoxyphenyl)ethylamino]-2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]pyridine-3-carbonitrile

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]pyridine-3-carbonitrile Openeye Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-2-[2-hydroxy-3-(isopropylamino)propoxy]pyridine-3-carbonitrile CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-2-[2-hydroxy-3-(propan-2-ylamino)propoxy]-3-pyridinecarbonitrile IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-2-[2-hydroxy-3-(propan-2-ylamino)propoxy]pyridine-3-carbonitrile Traditional Name: 4-(homoveratrylamino)-2-[2-hydroxy-3-(isopropylamino)propoxy]nicotinonitrile Formula: C22H30N4O4 MolecularWeight: 414.498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=NC=CC(=C1C#N)NCCC2=CC(=C(C=C2)OC)OC)O

Isomeric SMILES

CC(C)NCC(COC1=NC=CC(=C1C#N)NCCC2=CC(=C(C=C2)OC)OC)O

InChI

InChI=1S/C22H30N4O4/c1-15(2)26-13-17(27)14-30-22-18(12-23)19(8-10-25-22)24-9-7-16-5-6-20(28-3)21(11-16)29-4/h5-6,8,10-11,15,17,26-27H,7,9,13-14H2,1-4H3,(H,24,25)