[8-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]-piperidin-1-yl-methanone

Systemtic Name: [8-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]-piperidin-1-yl-methanone Openeye Name: [8-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]-(1-piperidyl)methanone CAS Name: [8-methyl-3-[(4-phenyl-1-piperazin-1-iumyl)methyl]-2-imidazo[1,2-a]pyridinyl]-(1-piperidinyl)methanone IUPAC Name: [8-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]-piperidin-1-ylmethanone Traditional Name: [8-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]-piperidino-methanone Formula: C25H32N5O+ MolecularWeight: 418.55448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C2C[NH+]3CCN(CC3)C4=CC=CC=C4)C(=O)N5CCCCC5

Isomeric SMILES

CC1=CC=CN2C1=NC(=C2C[NH+]3CCN(CC3)C4=CC=CC=C4)C(=O)N5CCCCC5

InChI

InChI=1S/C25H31N5O/c1-20-9-8-14-30-22(23(26-24(20)30)25(31)29-12-6-3-7-13-29)19-27-15-17-28(18-16-27)21-10-4-2-5-11-21/h2,4-5,8-11,14H,3,6-7,12-13,15-19H2,1H3/p+1