6-methoxy-2-[4-[(3S)-3-methoxypiperidin-1-ium-1-yl]piperidin-1-yl]-4-methyl-quinazoline

Systemtic Name: 6-methoxy-2-[4-[(3S)-3-methoxypiperidin-1-ium-1-yl]piperidin-1-yl]-4-methyl-quinazoline Openeye Name: 6-methoxy-2-[4-[(3S)-3-methoxypiperidin-1-ium-1-yl]-1-piperidyl]-4-methyl-quinazoline CAS Name: 6-methoxy-2-[4-[(3S)-3-methoxy-1-piperidin-1-iumyl]-1-piperidinyl]-4-methylquinazoline IUPAC Name: 6-methoxy-2-[4-[(3S)-3-methoxypiperidin-1-ium-1-yl]piperidin-1-yl]-4-methylquinazoline Traditional Name: 6-methoxy-2-[4-[(3S)-3-methoxypiperidin-1-ium-1-yl]piperidino]-4-methyl-quinazoline Formula: C21H31N4O2+ MolecularWeight: 371.49644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=C(C=C2)OC)N3CCC(CC3)[NH+]4CCCC(C4)OC

Isomeric SMILES

CC1=NC(=NC2=C1C=C(C=C2)OC)N3CCC(CC3)[NH+]4CCC[C@@H](C4)OC

InChI

InChI=1S/C21H30N4O2/c1-15-19-13-17(26-2)6-7-20(19)23-21(22-15)24-11-8-16(9-12-24)25-10-4-5-18(14-25)27-3/h6-7,13,16,18H,4-5,8-12,14H2,1-3H3/p+1/t18-/m0/s1