3-tert-butyl-7-[2-(4-phenylpiperazin-1-yl)ethylamino]-14H-naphtho[3,2-a]phenoxazine-8,13-dione

Systemtic Name: 3-tert-butyl-7-[2-(4-phenylpiperazin-1-yl)ethylamino]-14H-naphtho[3,2-a]phenoxazine-8,13-dione Openeye Name: 3-tert-butyl-7-[2-(4-phenylpiperazin-1-yl)ethylamino]-14H-naphtho[3,2-a]phenoxazine-8,13-dione CAS Name: 3-tert-butyl-7-[2-(4-phenyl-1-piperazinyl)ethylamino]-14H-naphtho[3,2-a]phenoxazine-8,13-dione IUPAC Name: 3-tert-butyl-7-[2-(4-phenylpiperazin-1-yl)ethylamino]-14H-naphtho[3,2-a]phenoxazine-8,13-dione Traditional Name: 3-tert-butyl-7-[2-(4-phenylpiperazino)ethylamino]-14H-naphtho[3,2-a]phenoxazine-8,13-quinone Formula: C36H36N4O3 MolecularWeight: 572.69604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)NC3=C(O2)C=C(C4=C3C(=O)C5=CC=CC=C5C4=O)NCCN6CCN(CC6)C7=CC=CC=C7

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)NC3=C(O2)C=C(C4=C3C(=O)C5=CC=CC=C5C4=O)NCCN6CCN(CC6)C7=CC=CC=C7

InChI

InChI=1S/C36H36N4O3/c1-36(2,3)23-13-14-27-29(21-23)43-30-22-28(37-15-16-39-17-19-40(20-18-39)24-9-5-4-6-10-24)31-32(33(30)38-27)35(42)26-12-8-7-11-25(26)34(31)41/h4-14,21-22,37-38H,15-20H2,1-3H3