8-nitro-2-(4-phenylbutyl)-4-propan-2-yl-11-(2-pyridin-4-ylethyl)-4,11a-dihydro-1H-pyrazino[2,1-b]quinazoline-3,6-dione

Systemtic Name: 8-nitro-2-(4-phenylbutyl)-4-propan-2-yl-11-(2-pyridin-4-ylethyl)-4,11a-dihydro-1H-pyrazino[2,1-b]quinazoline-3,6-dione Openeye Name: 4-isopropyl-8-nitro-2-(4-phenylbutyl)-11-[2-(4-pyridyl)ethyl]-4,11a-dihydro-1H-pyrazino[2,1-b]quinazoline-3,6-dione CAS Name: 8-nitro-2-(4-phenylbutyl)-4-propan-2-yl-11-(2-pyridin-4-ylethyl)-4,11a-dihydro-1H-pyrazino[2,1-b]quinazoline-3,6-dione IUPAC Name: 8-nitro-2-(4-phenylbutyl)-4-propan-2-yl-11-(2-pyridin-4-ylethyl)-4,11a-dihydro-1H-pyrazino[2,1-b]quinazoline-3,6-dione Traditional Name: 4-isopropyl-8-nitro-2-(4-phenylbutyl)-11-[2-(4-pyridyl)ethyl]-4,11a-dihydro-1H-pyrazino[2,1-b]quinazoline-3,6-quinone Formula: C31H35N5O4 MolecularWeight: 541.6407

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(CC2N1C(=O)C3=C(N2CCC4=CC=NC=C4)C=CC(=C3)[N+](=O)[O-])CCCCC5=CC=CC=C5

Isomeric SMILES

CC(C)C1C(=O)N(CC2N1C(=O)C3=C(N2CCC4=CC=NC=C4)C=CC(=C3)[N+](=O)[O-])CCCCC5=CC=CC=C5

InChI

InChI=1S/C31H35N5O4/c1-22(2)29-31(38)33(18-7-6-10-23-8-4-3-5-9-23)21-28-34(19-15-24-13-16-32-17-14-24)27-12-11-25(36(39)40)20-26(27)30(37)35(28)29/h3-5,8-9,11-14,16-17,20,22,28-29H,6-7,10,15,18-19,21H2,1-2H3