1-[(2R)-1-(4-ethylpiperazin-4-ium-1-yl)-1-oxidanylidene-propan-2-yl]-3-(phenylmethyl)quinazoline-2,4-dione

Systemtic Name: 1-[(2R)-1-(4-ethylpiperazin-4-ium-1-yl)-1-oxidanylidene-propan-2-yl]-3-(phenylmethyl)quinazoline-2,4-dione Openeye Name: 3-benzyl-1-[(1R)-2-(4-ethylpiperazin-4-ium-1-yl)-1-methyl-2-oxo-ethyl]quinazoline-2,4-dione CAS Name: 1-[(2R)-1-(4-ethyl-1-piperazin-4-iumyl)-1-oxopropan-2-yl]-3-(phenylmethyl)quinazoline-2,4-dione IUPAC Name: 3-benzyl-1-[(2R)-1-(4-ethylpiperazin-4-ium-1-yl)-1-oxopropan-2-yl]quinazoline-2,4-dione Traditional Name: 3-benzyl-1-[(1R)-2-(4-ethylpiperazin-4-ium-1-yl)-2-keto-1-methyl-ethyl]quinazoline-2,4-quinone Formula: C24H29N4O3+ MolecularWeight: 421.51206

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C(C)N2C3=CC=CC=C3C(=O)N(C2=O)CC4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)[C@@H](C)N2C3=CC=CC=C3C(=O)N(C2=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H28N4O3/c1-3-25-13-15-26(16-14-25)22(29)18(2)28-21-12-8-7-11-20(21)23(30)27(24(28)31)17-19-9-5-4-6-10-19/h4-12,18H,3,13-17H2,1-2H3/p+1/t18-/m1/s1