(4E)-4-(6-methoxy-1H-pyridin-2-ylidene)-2-[[(6-methyl-6-oxidanyl-heptan-2-yl)amino]methyl]cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-4-(6-methoxy-1H-pyridin-2-ylidene)-2-[[(6-methyl-6-oxidanyl-heptan-2-yl)amino]methyl]cyclohexa-2,5-dien-1-one Openeye Name: (4E)-2-[[(5-hydroxy-1,5-dimethyl-hexyl)amino]methyl]-4-(6-methoxy-1H-pyridin-2-ylidene)cyclohexa-2,5-dien-1-one CAS Name: (4E)-2-[[(6-hydroxy-6-methylheptan-2-yl)amino]methyl]-4-(6-methoxy-1H-pyridin-2-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-2-[[(6-hydroxy-6-methylheptan-2-yl)amino]methyl]-4-(6-methoxy-1H-pyridin-2-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: (4E)-2-[[(5-hydroxy-1,5-dimethyl-hexyl)amino]methyl]-4-(6-methoxy-1H-pyridin-2-ylidene)cyclohexa-2,5-dien-1-one Formula: C21H30N2O3 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)(C)O)NCC1=CC(=C2C=CC=C(N2)OC)C=CC1=O

Isomeric SMILES

CC(CCCC(C)(C)O)NCC1=C/C(=C/2\C=CC=C(N2)OC)/C=CC1=O

InChI

InChI=1S/C21H30N2O3/c1-15(7-6-12-21(2,3)25)22-14-17-13-16(10-11-19(17)24)18-8-5-9-20(23-18)26-4/h5,8-11,13,15,22-23,25H,6-7,12,14H2,1-4H3/b18-16+