(6E)-6-[6-azanyl-5-(phenoxymethyl)-4-piperidin-4-yl-1H-pyridin-2-ylidene]-5-(cyclopropylmethoxy)cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[6-azanyl-5-(phenoxymethyl)-4-piperidin-4-yl-1H-pyridin-2-ylidene]-5-(cyclopropylmethoxy)cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[6-amino-5-(phenoxymethyl)-4-(4-piperidyl)-1H-pyridin-2-ylidene]-5-(cyclopropylmethoxy)cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[6-amino-5-(phenoxymethyl)-4-(4-piperidinyl)-1H-pyridin-2-ylidene]-5-(cyclopropylmethoxy)-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[6-amino-5-(phenoxymethyl)-4-piperidin-4-yl-1H-pyridin-2-ylidene]-5-(cyclopropylmethoxy)cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[6-amino-5-(phenoxymethyl)-4-(4-piperidyl)-1H-pyridin-2-ylidene]-5-(cyclopropylmethoxy)cyclohexa-2,4-dien-1-one Formula: C27H31N3O3 MolecularWeight: 445.55334

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1COC2=CC=CC(=O)C2=C3C=C(C(=C(N3)N)COC4=CC=CC=C4)C5CCNCC5

Isomeric SMILES

C1CC1COC\2=CC=CC(=O)/C2=C/3\C=C(C(=C(N3)N)COC4=CC=CC=C4)C5CCNCC5

InChI

InChI=1S/C27H31N3O3/c28-27-22(17-32-20-5-2-1-3-6-20)21(19-11-13-29-14-12-19)15-23(30-27)26-24(31)7-4-8-25(26)33-16-18-9-10-18/h1-8,15,18-19,29-30H,9-14,16-17,28H2/b26-23-