[3-[2-[(triphenylmethyl)amino]ethyl]-1H-indol-5-yl] 2-(phenylmethoxycarbonylamino)ethanoate

Systemtic Name: [3-[2-[(triphenylmethyl)amino]ethyl]-1H-indol-5-yl] 2-(phenylmethoxycarbonylamino)ethanoate Openeye Name: [3-[2-(tritylamino)ethyl]-1H-indol-5-yl] 2-(benzyloxycarbonylamino)acetate CAS Name: 2-(phenylmethoxycarbonylamino)acetic acid [3-[2-[(triphenylmethyl)amino]ethyl]-1H-indol-5-yl] ester IUPAC Name: [3-[2-(tritylamino)ethyl]-1H-indol-5-yl] 2-(phenylmethoxycarbonylamino)acetate Traditional Name: 2-(benzyloxycarbonylamino)acetic acid [3-[2-(tritylamino)ethyl]-1H-indol-5-yl] ester Formula: C39H35N3O4 MolecularWeight: 609.7129

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCC(=O)OC2=CC3=C(C=C2)NC=C3CCNC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCC(=O)OC2=CC3=C(C=C2)NC=C3CCNC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C39H35N3O4/c43-37(27-41-38(44)45-28-29-13-5-1-6-14-29)46-34-21-22-36-35(25-34)30(26-40-36)23-24-42-39(31-15-7-2-8-16-31,32-17-9-3-10-18-32)33-19-11-4-12-20-33/h1-22,25-26,40,42H,23-24,27-28H2,(H,41,44)