1-(4-ethylpiperazin-1-yl)-3-[1-(3-methoxyphenyl)prop-2-enyl]isoquinoline

Systemtic Name: 1-(4-ethylpiperazin-1-yl)-3-[1-(3-methoxyphenyl)prop-2-enyl]isoquinoline Openeye Name: 1-(4-ethylpiperazin-1-yl)-3-[1-(3-methoxyphenyl)allyl]isoquinoline CAS Name: 1-(4-ethyl-1-piperazinyl)-3-[1-(3-methoxyphenyl)prop-2-enyl]isoquinoline IUPAC Name: 1-(4-ethylpiperazin-1-yl)-3-[1-(3-methoxyphenyl)prop-2-enyl]isoquinoline Traditional Name: 1-(4-ethylpiperazino)-3-[1-(3-methoxyphenyl)allyl]isoquinoline Formula: C25H29N3O MolecularWeight: 387.51726

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C(C=C)C4=CC(=CC=C4)OC

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C(C=C)C4=CC(=CC=C4)OC

InChI

InChI=1S/C25H29N3O/c1-4-22(19-10-8-11-21(17-19)29-3)24-18-20-9-6-7-12-23(20)25(26-24)28-15-13-27(5-2)14-16-28/h4,6-12,17-18,22H,1,5,13-16H2,2-3H3