(6Z)-6-indol-3-ylidene-2-[4-(morpholin-4-ylmethyl)phenyl]-1H-pyrimidin-3-ium-4-one

Systemtic Name: (6Z)-6-indol-3-ylidene-2-[4-(morpholin-4-ylmethyl)phenyl]-1H-pyrimidin-3-ium-4-one Openeye Name: (6Z)-6-indol-3-ylidene-2-[4-(morpholinomethyl)phenyl]-1H-pyrimidin-3-ium-4-one CAS Name: (6Z)-6-(3-indolylidene)-2-[4-(4-morpholinylmethyl)phenyl]-1H-pyrimidin-3-ium-4-one IUPAC Name: (6Z)-6-indol-3-ylidene-2-[4-(morpholin-4-ylmethyl)phenyl]-1H-pyrimidin-3-ium-4-one Traditional Name: (6Z)-6-indol-3-ylidene-2-[4-(morpholinomethyl)phenyl]-1H-pyrimidin-3-ium-4-one Formula: C23H23N4O2+ MolecularWeight: 387.45432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC=C(C=C2)C3=[NH+]C(=O)CC(=C4C=NC5=CC=CC=C54)N3

Isomeric SMILES

C1COCCN1CC2=CC=C(C=C2)C3=[NH+]C(=O)C/C(=C\4/C=NC5=CC=CC=C54)/N3

InChI

InChI=1S/C23H22N4O2/c28-22-13-21(19-14-24-20-4-2-1-3-18(19)20)25-23(26-22)17-7-5-16(6-8-17)15-27-9-11-29-12-10-27/h1-8,14H,9-13,15H2,(H,25,26,28)/p+1/b21-19+