prop-2-enyl (2S)-5-[bis(azanyl)methylideneamino]-2-(naphthalen-2-ylmethylamino)pentanoate

Systemtic Name: prop-2-enyl (2S)-5-[bis(azanyl)methylideneamino]-2-(naphthalen-2-ylmethylamino)pentanoate Openeye Name: allyl (2S)-5-guanidino-2-(2-naphthylmethylamino)pentanoate CAS Name: (2S)-5-(diaminomethylideneamino)-2-(2-naphthalenylmethylamino)pentanoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2S)-5-(diaminomethylideneamino)-2-(naphthalen-2-ylmethylamino)pentanoate Traditional Name: (2S)-5-guanidino-2-(2-naphthylmethylamino)valeric acid allyl ester Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C(CCCN=C(N)N)NCC1=CC2=CC=CC=C2C=C1

Isomeric SMILES

C=CCOC(=O)[C@H](CCCN=C(N)N)NCC1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C20H26N4O2/c1-2-12-26-19(25)18(8-5-11-23-20(21)22)24-14-15-9-10-16-6-3-4-7-17(16)13-15/h2-4,6-7,9-10,13,18,24H,1,5,8,11-12,14H2,(H4,21,22,23)/t18-/m0/s1