3-tert-butyl-7-(3-pyrrolidin-1-ylpropylamino)-14H-naphtho[3,2-a]phenoxazine-8,13-dione

Systemtic Name: 3-tert-butyl-7-(3-pyrrolidin-1-ylpropylamino)-14H-naphtho[3,2-a]phenoxazine-8,13-dione Openeye Name: 3-tert-butyl-7-(3-pyrrolidin-1-ylpropylamino)-14H-naphtho[3,2-a]phenoxazine-8,13-dione CAS Name: 3-tert-butyl-7-[3-(1-pyrrolidinyl)propylamino]-14H-naphtho[3,2-a]phenoxazine-8,13-dione IUPAC Name: 3-tert-butyl-7-(3-pyrrolidin-1-ylpropylamino)-14H-naphtho[3,2-a]phenoxazine-8,13-dione Traditional Name: 3-tert-butyl-7-(3-pyrrolidinopropylamino)-14H-naphtho[3,2-a]phenoxazine-8,13-quinone Formula: C31H33N3O3 MolecularWeight: 495.61202

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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)NCCCN6CCCC6

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)NC3=C(O2)C=C(C4=C3C(=O)C5=CC=CC=C5C4=O)NCCCN6CCCC6

InChI

InChI=1S/C31H33N3O3/c1-31(2,3)19-11-12-22-24(17-19)37-25-18-23(32-13-8-16-34-14-6-7-15-34)26-27(28(25)33-22)30(36)21-10-5-4-9-20(21)29(26)35/h4-5,9-12,17-18,32-33H,6-8,13-16H2,1-3H3