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(E)-2-[2-(azepan-1-yl)-1-methoxy-cyclopentyl]-6-oxidanylidene-2-(4-phenylphenyl)hex-4-enoic acid

(E)-2-[2-(azepan-1-yl)-1-methoxy-cyclopentyl]-6-oxidanylidene-2-(4-phenylphenyl)hex-4-enoic acid

Systemtic Name:(E)-2-[2-(azepan-1-yl)-1-methoxy-cyclopentyl]-6-oxidanylidene-2-(4-phenylphenyl)hex-4-enoic acid
Openeye Name:(E)-2-[2-(azepan-1-yl)-1-methoxy-cyclopentyl]-6-oxo-2-(4-phenylphenyl)hex-4-enoic acid
CAS Name:(E)-2-[2-(1-azepanyl)-1-methoxycyclopentyl]-6-oxo-2-(4-phenylphenyl)-4-hexenoic acid
IUPAC Name:(E)-2-[2-(azepan-1-yl)-1-methoxycyclopentyl]-6-oxo-2-(4-phenylphenyl)hex-4-enoic acid
Traditional Name:(E)-2-[2-(azepan-1-yl)-1-methoxy-cyclopentyl]-6-keto-2-(4-phenylphenyl)hex-4-enoic acid
Formula: C30H37NO4
MolecularWeight: 475.61908
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Descriptors Computed from Structure

Canonical SMILES:

COC1(CCCC1N2CCCCCC2)C(CC=CC=O)(C3=CC=C(C=C3)C4=CC=CC=C4)C(=O)O


Isomeric SMILES

COC1(CCCC1N2CCCCCC2)C(C/C=C/C=O)(C3=CC=C(C=C3)C4=CC=CC=C4)C(=O)O


InChI

InChI=1S/C30H37NO4/c1-35-30(20-11-14-27(30)31-21-8-2-3-9-22-31)29(28(33)34,19-7-10-23-32)26-17-15-25(16-18-26)24-12-5-4-6-13-24/h4-7,10,12-13,15-18,23,27H,2-3,8-9,11,14,19-22H2,1H3,(H,33,34)/b10-7+


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