3-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]carbonyl-8-prop-2-enyl-chromen-2-one

Systemtic Name: 3-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]carbonyl-8-prop-2-enyl-chromen-2-one Openeye Name: 8-allyl-3-[4-[(E)-cinnamyl]piperazin-4-ium-1-carbonyl]chromen-2-one CAS Name: 3-[oxo-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]methyl]-8-prop-2-enyl-1-benzopyran-2-one IUPAC Name: 3-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carbonyl]-8-prop-2-enylchromen-2-one Traditional Name: 8-allyl-3-[4-[(E)-cinnamyl]piperazin-4-ium-1-carbonyl]coumarin Formula: C26H27N2O3+ MolecularWeight: 415.50418

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC2=C1OC(=O)C(=C2)C(=O)N3CC[NH+](CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

C=CCC1=CC=CC2=C1OC(=O)C(=C2)C(=O)N3CC[NH+](CC3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C26H26N2O3/c1-2-8-21-12-6-13-22-19-23(26(30)31-24(21)22)25(29)28-17-15-27(16-18-28)14-7-11-20-9-4-3-5-10-20/h2-7,9-13,19H,1,8,14-18H2/p+1/b11-7+