(Z)-3-(7-methyl-2-morpholin-4-yl-quinolin-1-ium-3-yl)-2-(4-nitrophenyl)prop-2-enenitrile

Systemtic Name: (Z)-3-(7-methyl-2-morpholin-4-yl-quinolin-1-ium-3-yl)-2-(4-nitrophenyl)prop-2-enenitrile Openeye Name: (Z)-3-(7-methyl-2-morpholino-quinolin-1-ium-3-yl)-2-(4-nitrophenyl)prop-2-enenitrile CAS Name: (Z)-3-[7-methyl-2-(4-morpholinyl)-3-quinolin-1-iumyl]-2-(4-nitrophenyl)-2-propenenitrile IUPAC Name: (Z)-3-(7-methyl-2-morpholin-4-ylquinolin-1-ium-3-yl)-2-(4-nitrophenyl)prop-2-enenitrile Traditional Name: (Z)-3-(7-methyl-2-morpholino-quinolin-1-ium-3-yl)-2-(4-nitrophenyl)acrylonitrile Formula: C23H21N4O3+ MolecularWeight: 401.43784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=[NH+]C(=C(C=C2C=C1)C=C(C#N)C3=CC=C(C=C3)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

CC1=CC2=[NH+]C(=C(C=C2C=C1)/C=C(\C#N)/C3=CC=C(C=C3)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C23H20N4O3/c1-16-2-3-18-13-19(23(25-22(18)12-16)26-8-10-30-11-9-26)14-20(15-24)17-4-6-21(7-5-17)27(28)29/h2-7,12-14H,8-11H2,1H3/p+1/b20-14+